SCHEMBL14199559

SCHEMBL14199559

CP(=O)(O)C(C[n+]1cccc(C(=O)c2ccccc2)c1)P(=O)(O)O

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ GGPS1 O95749 15/20 0.52
▸ FDPS P14324 2/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ CYP2D6 P10635 1/20 0.39
▸ PABPC1 P11940 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ ATM Q13315 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL12060630 0.92 GGPS1 (0.57) GGPS1FDPSNPSR1L3MBTL1CYP2D6
SCHEMBL12435684 0.83 GGPS1 (0.48) GGPS1FDPSNPSR1L3MBTL1CYP2D6
SCHEMBL14199553 0.82 GGPS1 (0.75) GGPS1FDPS
SCHEMBL14199572 0.80 GGPS1 (0.53) GGPS1FDPSNPSR1L3MBTL1
SCHEMBL14199557 0.78 GGPS1 (0.74) GGPS1FDPSKMT2A
SCHEMBL14199582 0.78 GGPS1 (0.55) GGPS1FDPS
SCHEMBL14199556 0.78 GGPS1 (0.55) GGPS1FDPS
SCHEMBL14199570 0.78 GGPS1 (0.55) GGPS1FDPS
SCHEMBL12257842 0.77 GGPS1 (0.57) GGPS1FDPS
SCHEMBL12060532 0.76 GGPS1 (0.70) GGPS1FDPS

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7358361-B2 Biophosphonate compounds and methods for bone resorption diseases, cancer, bone pain, immune disorders, and infectious diseases THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2008-04-15 — — US disclosed
Send feedback